Geometry & MOs

Info

ID:	202764
PubChem CID:	79722927
Reduced:	BrON3C14H22 (1)
Stoich.:	ABC3D14E22 (1)
Weight, g/mol:	247.100857
ΔH_f, kcal/mol:	-39.36
Dipole, Da:	2.64
IP(EA), eV:	-8.77(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-fluoropyridin-2-yl)-2-(3-methoxyphenyl)ethanol

Drug info:

PubChemData

Smile

CC(C)C(CNC(=O)C1=C(C=C(C=C1)Br)N)N(C)C

DOS

IR

Vibrations